IBS-ZINC04844212 MOE2007 3D Structure written by MMmdl. 43 43 0 0 1 0 0 0 0 0999 V2000 1.0040 1.0830 -3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 2.2410 -2.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3020 2.7520 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 3.2760 -1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 2.9330 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 2.0350 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 1.2900 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6530 1.4970 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.8170 -1.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1970 2.7520 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 0.8770 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 0.7190 -3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 1.3580 -4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 0.4600 -4.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 2.7620 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.2200 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 3.6730 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 0.6070 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 0.3200 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 1.4530 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 4.2500 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 3.4060 -2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 1.8300 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -0.0760 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 0.6860 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -0.2940 -3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 0.6890 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 1.4330 -5.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 0.3510 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 0.8750 -5.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -0.5400 -5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 2.7560 -3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 3.4620 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 3.1590 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.5030 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.7860 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -0.5620 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 3.3980 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9230 3.4530 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 4.7520 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 1.5060 -2.7960 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0740 1.6290 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 2.4500 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 41 1 M END